3-azaspiro[5.5]undecan-9-ol;hydrochloride

C10H20ClNO — CID 119057057

IUPAC3-azaspiro[5.5]undecan-9-ol;hydrochloride
SMILESCl.OC1CCC2(CCNCC2)CC1
InChIInChI=1S/C10H19NO.ClH/c12-9-1-3-10(4-2-9)5-7-11-8-6-10;/h9,11-12H,1-8H2;1H
InChIKeyXHCLAZHXETUXJC-UHFFFAOYSA-N
MW205.73 g/mol
LogP1.71
Rot. Bonds

About 3-azaspiro[5.5]undecan-9-ol;hydrochloride

3-azaspiro[5.5]undecan-9-ol;hydrochloride (PubChem CID 119057057) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is 3-azaspiro[5.5]undecan-9-ol;hydrochloride.

Molecular Properties

Compound Name3-azaspiro[5.5]undecan-9-ol;hydrochloride
PubChem CID119057057
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name3-azaspiro[5.5]undecan-9-ol;hydrochloride
SMILESCl.OC1CCC2(CCNCC2)CC1
InChIInChI=1S/C10H19NO.ClH/c12-9-1-3-10(4-2-9)5-7-11-8-6-10;/h9,11-12H,1-8H2;1H
InChIKeyXHCLAZHXETUXJC-UHFFFAOYSA-N
XLogP1.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-azaspiro[5.5]undecan-9-ol;hydrochloride?
The IUPAC name of 3-azaspiro[5.5]undecan-9-ol;hydrochloride (CID 119057057) is 3-azaspiro[5.5]undecan-9-ol;hydrochloride.
What is the SMILES notation for 3-azaspiro[5.5]undecan-9-ol;hydrochloride?
The canonical SMILES for 3-azaspiro[5.5]undecan-9-ol;hydrochloride is Cl.OC1CCC2(CCNCC2)CC1.
What is the InChIKey of 3-azaspiro[5.5]undecan-9-ol;hydrochloride?
The InChIKey is XHCLAZHXETUXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.ClH/c12-9-1-3-10(4-2-9)5-7-11-8-6-10;/h9,11-12H,1-8H2;1H.
What are the key properties of 3-azaspiro[5.5]undecan-9-ol;hydrochloride?
3-azaspiro[5.5]undecan-9-ol;hydrochloride has a molecular weight of 205.73 g/mol, XLogP of 1.71, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azaspiro[5.5]undecan-9-ol;hydrochloride is sourced from PubChem (CID 119057057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).